Methyl 4-(4-hydroxybutyl)-5-(1,3-dithialan-2-ylmethyl)-7-oxo-8-methylfurano[4,5-e]indole-3-carboxylate

SpectraBase Compound ID	KTX8Vs6iej2
InChI	InChI=1S/C21H33NO5S2/c1-12-17-14-6-7-22(21(25)26-2)18(14)13(5-3-4-8-23)15(19(17)27-20(12)24)11-16-28-9-10-29-16/h12-19,23H,3-11H2,1-2H3/t12-,13+,14-,15+,17+,18+,19-/m0/s1
InChIKey	DYQHUXBALDUTDX-YYLDABFHSA-N Google Search
Mol Weight	443.6 g/mol
Molecular Formula	C21H33NO5S2
Exact Mass	443.180016 g/mol

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SpectraBase Spectrum ID	IAUzginSHJj
Name	Methyl 4-(4-hydroxybutyl)-5-(1,3-dithialan-2-ylmethyl)-7-oxo-8-methylfurano[4,5-e]indole-3-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H33NO5S2
InChI	InChI=1S/C21H33NO5S2/c1-12-17-14-6-7-22(21(25)26-2)18(14)13(5-3-4-8-23)15(19(17)27-20(12)24)11-16-28-9-10-29-16/h12-19,23H,3-11H2,1-2H3/t12-,13+,14-,15+,17+,18+,19-/m0/s1
InChIKey	DYQHUXBALDUTDX-YYLDABFHSA-N
Molecular Weight	443.617 g/mol
SMILES	OCCCC[C@@]1([C@]([C@@]2(OC([C@]([C@@]2([C@]2([C@@]1(N(C(=O)OC)CC2)[H])[H])[H])(C)[H])=O)[H])(CC1SCCS1)[H])[H]
SPLASH	splash10-06di-0904100000-baf5e46dea4ea9d26ac6
Source of Spectrum	QE-7-4114-35
Wiley ID	846053